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CAS 85730-33-2

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4-methoxy-2-(methylsulfanyl)-6-(trifluoromethyl)pyrimidine

Description:
4-Methoxy-2-(methylsulfanyl)-6-(trifluoromethyl)pyrimidine, with the CAS number 85730-33-2, is a heterocyclic organic compound characterized by its pyrimidine ring structure, which is a six-membered aromatic ring containing two nitrogen atoms at positions 1 and 3. This compound features a methoxy group (-OCH3) at the 4-position, a methylsulfanyl group (-S-CH3) at the 2-position, and a trifluoromethyl group (-CF3) at the 6-position, contributing to its unique chemical properties. The presence of the trifluoromethyl group enhances lipophilicity and can influence biological activity, while the methoxy and methylsulfanyl groups may affect solubility and reactivity. This compound is of interest in medicinal chemistry and agrochemicals due to its potential biological activities, including antimicrobial and herbicidal properties. Its synthesis typically involves multi-step reactions, and it may be analyzed using techniques such as NMR spectroscopy and mass spectrometry to confirm its structure and purity.
Formula:C7H7F3N2OS
InChI:InChI=1/C7H7F3N2OS/c1-13-5-3-4(7(8,9)10)11-6(12-5)14-2/h3H,1-2H3
SMILES:COc1cc(C(F)(F)F)nc(n1)SC
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